3-chloranyl-N-(3-methoxypropylcarbamothioyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(3-methoxypropylcarbamothioyl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(3-methoxypropylcarbamothioyl)benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(3-methoxypropylamino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(3-methoxypropylcarbamothioyl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(3-methoxypropylthiocarbamoyl)benzothiophene-2-carboxamide Formula: C14H15ClN2O2S2 MolecularWeight: 342.8641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NC(=O)C1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

COCCCNC(=S)NC(=O)C1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C14H15ClN2O2S2/c1-19-8-4-7-16-14(20)17-13(18)12-11(15)9-5-2-3-6-10(9)21-12/h2-3,5-6H,4,7-8H2,1H3,(H2,16,17,18,20)